N4-[(3-chlorophenyl)methyl]-N4-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]cyclohexane-1,4-diamine

Systemtic Name: N4-[(3-chlorophenyl)methyl]-N4-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]cyclohexane-1,4-diamine Openeye Name: N4-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N4-[(3-chlorophenyl)methyl]cyclohexane-1,4-diamine CAS Name: N4-[(3-chlorophenyl)methyl]-N4-[(3-methoxy-4-phenylmethoxyphenyl)methyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[(3-chlorophenyl)methyl]-4-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-(4-benzoxy-3-methoxy-benzyl)-(3-chlorobenzyl)amine Formula: C28H33ClN2O2 MolecularWeight: 465.02682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(CC2=CC(=CC=C2)Cl)C3CCC(CC3)N)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CN(CC2=CC(=CC=C2)Cl)C3CCC(CC3)N)OCC4=CC=CC=C4

InChI

InChI=1S/C28H33ClN2O2/c1-32-28-17-23(10-15-27(28)33-20-21-6-3-2-4-7-21)19-31(26-13-11-25(30)12-14-26)18-22-8-5-9-24(29)16-22/h2-10,15-17,25-26H,11-14,18-20,30H2,1H3